SCHEMBL6301168

SCHEMBL6301168

CCCCc1ccc(CO)c(Cl)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SKP2 Q13309 1/20 0.43
SIGMAR1 Q99720 2/20 0.43
HPGD P15428 2/20 0.43
NPC1 O15118 1/20 0.43
MAPK1 P28482 1/20 0.43
HTT P42858 1/20 0.43
RAB9A P51151 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
IGF1R P08069 1/20 0.42
ALOX15 P16050 1/20 0.42
GLA P06280 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
AKR1C2 P52895 1/20 0.41
AKR1C1 Q04828 1/20 0.41
ALDH1A1 P00352 2/20 0.41
HSD17B10 Q99714 2/20 0.41
TYR P14679 1/20 0.41
S1PR1 P21453 1/20 0.40

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6300617 0.95 ESR1 (0.46) SIGMAR1IGF1RALOX15ALDH1A1HSD17B10
SCHEMBL6301584 0.84 SKP2 (0.44) SKP2SIGMAR1HPGDNPC1MAPK1
SCHEMBL18199330 0.83 TYR (0.48) SKP2HPGDNPC1MAPK1HTT
SCHEMBL20657270 0.81 TYR (0.47) SKP2HPGDNPC1MAPK1HTT
SCHEMBL8772771 0.81 TRPA1 (0.43) SIGMAR1MAPK1SMN1; SMN2LMNA
SCHEMBL19000295 0.81 ESR1 (0.46) SIGMAR1IGF1RALOX15ALDH1A1HSD17B10
SCHEMBL9177318 0.79 SIGMAR1 (0.62) SKP2SIGMAR1IGF1RALOX15GLA
SCHEMBL9399168 0.79 ESR1 (0.47) SIGMAR1ALDH1A1HSD17B10S1PR1ESR1
SCHEMBL522987 0.78 RECQL (0.43) HPGDNPC1MAPK1HTTRAB9A
SCHEMBL574235 0.78 IGF1R (0.58) HPGDNPC1MAPK1HTTRAB9A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6869950-B1 Benzimidazole derivatives FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2005-03-22 US disclosed
EP-1142880-A1 BENZIMIDAZOLE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-10-10 EP disclosed